(8aS)-2-(phenylmethyl)-4-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)-3,8a-dihydrophthalazin-1-one

Systemtic Name: (8aS)-2-(phenylmethyl)-4-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)-3,8a-dihydrophthalazin-1-one Openeye Name: (8aS)-2-benzyl-4-(2-thioxo-3H-1,3,4-oxadiazol-5-yl)-3,8a-dihydrophthalazin-1-one CAS Name: (8aS)-2-(phenylmethyl)-4-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)-3,8a-dihydrophthalazin-1-one IUPAC Name: (8aS)-2-benzyl-4-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)-3,8a-dihydrophthalazin-1-one Traditional Name: (8aS)-2-benzyl-4-(2-thioxo-3H-1,3,4-oxadiazol-5-yl)-3,8a-dihydrophthalazin-1-one Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3C=CC=CC3=C(N2)C4=NNC(=S)O4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)[C@H]3C=CC=CC3=C(N2)C4=NNC(=S)O4

InChI

InChI=1S/C17H14N4O2S/c22-16-13-9-5-4-8-12(13)14(15-18-19-17(24)23-15)20-21(16)10-11-6-2-1-3-7-11/h1-9,13,20H,10H2,(H,19,24)/t13-/m0/s1